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(3aR,5S,7aR)-5-ethoxy-7a-methyl-3,3a,4,5-tetrahydro-2H-1-benzofuran
SpectraBase Compound ID 9GP08emM3NX
InChI InChI=1S/C11H18O2/c1-3-12-10-4-6-11(2)9(8-10)5-7-13-11/h4,6,9-10H,3,5,7-8H2,1-2H3/t9-,10-,11+/m1/s1
InChIKey NVUOCBYKXWUKEN-MXWKQRLJSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TwyCvDDWOr
Name (3aR,5S,7aR)-5-ethoxy-7a-methyl-3,3a,4,5-tetrahydro-2H-1-benzofuran
Alternate Name(s) (3aR,5S,7aR)-5-ethoxy-7a-methyl-3,3a,4,5-tetrahydro-2H-benzofuran
CAS Registry Number 141612-63-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-3-12-10-4-6-11(2)9(8-10)5-7-13-11/h4,6,9-10H,3,5,7-8H2,1-2H3/t9-,10-,11+/m1/s1
InChIKey NVUOCBYKXWUKEN-MXWKQRLJSA-N
Molecular Weight 182.263 g/mol
SMILES [C@]12(C=C[C@](C[C@]2(CCO1)[H])(OCC)[H])C
SPLASH splash10-0006-9400000000-059050252df0f84ddbc8
Source of Spectrum C-114-6380-33
Wiley ID 1178895